Intramolecular coupling as a mechanism for a liquid-liquid phase transition

Franzese, Giancarlo; Marqués, Manuel I.; Stanley, H. Eugene (Harry Eugene)

Please use this identifier to cite or link to this item: http://hdl.handle.net/2445/18812

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DC Field	Value	Language
dc.contributor.author	Franzese, Giancarlo	cat
dc.contributor.author	Marqués, Manuel I.	cat
dc.contributor.author	Stanley, H. Eugene (Harry Eugene), 1941-	cat
dc.date.accessioned	2011-07-07T12:53:16Z	-
dc.date.available	2011-07-07T12:53:16Z	-
dc.date.issued	2003	-
dc.identifier.issn	1063-651X	-
dc.identifier.uri	http://hdl.handle.net/2445/18812	-
dc.description.abstract	We study a model for water with a tunable intramolecular interaction Js, using mean-field theory and off-lattice Monte Carlo simulations. For all Js>~0, the model displays a temperature of maximum density. For a finite intramolecular interaction Js>0, our calculations support the presence of a liquid-liquid phase transition with a possible liquid-liquid critical point for water, likely preempted by inevitable freezing. For J=0, the liquid-liquid critical point disappears at T=0.	eng
dc.format.extent	7 p.	-
dc.format.mimetype	application/pdf	-
dc.language.iso	eng	eng
dc.publisher	The American Physical Society	eng
dc.relation.isformatof	Reproducció del document publicat a: http://dx.doi.org/10.1103/PhysRevE.67.011103	cat
dc.relation.ispartof	Physical Review E, 2003, vol. 67, núm. 1, p. 011103-1-011103-7	-
dc.relation.uri	http://dx.doi.org/10.1103/PhysRevE.67.011103	-
dc.rights	(c) American Physical Society, 2003	-
dc.source	Articles publicats en revistes (Física de la Matèria Condensada)	-
dc.subject.classification	Equacions d'estat	cat
dc.subject.classification	Mètode de Montecarlo	cat
dc.subject.classification	Transformacions de fase (Física estadística)	cat
dc.subject.classification	Termodinàmica	cat
dc.subject.other	Equations of state	eng
dc.subject.other	Monte Carlo method	eng
dc.subject.other	Phase transformations (Statistical physics)	eng
dc.subject.other	Thermodynamics	eng
dc.title	Intramolecular coupling as a mechanism for a liquid-liquid phase transition	eng
dc.type	info:eu-repo/semantics/article	-
dc.type	info:eu-repo/semantics/publishedVersion	-
dc.identifier.idgrec	513998	-
dc.rights.accessRights	info:eu-repo/semantics/openAccess	-
Appears in Collections:	Articles publicats en revistes (Física de la Matèria Condensada)

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